BAS 04454153
TL;DR: BAS 04454153 (CAS 488103-60-2) is a chemical compound with molecular formula C20H20N2OS2 and molecular weight 368.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]-1-phenylethanone
Also Known As: BAS 04454153, 2-((2-ethyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-phenylethanone, 2-[(2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]-1-phenylethanone, 2-[(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]-1-phenylethanone
| Molecular Formula | C20H20N2OS2 |
|---|---|
| Molecular Weight | 368.10 g/mol |
| LogP | 5.1075 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.1017 |
| Heavy Atoms | 25 |
| Complexity | 918.3409 |
Chemical Identifiers
| CAS Number | 488103-60-2 |
|---|---|
| SMILES | CCC1=NC2=C(C3=C(S2)CCCC3)C(=N1)SCC(=O)C4=CC=CC=C4 |
Product Overview
BAS 04454153 (CAS 488103-60-2), with molecular formula C20H20N2OS2 and molecular weight 368.10 g/mol. IUPAC: 2-[(2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]-1-phenylethanone.
Chemical Property Profile of BAS 04454153
Property Insights of BAS 04454153
The XLogP value of 5.1075 indicates that BAS 04454153 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.85 Ų, BAS 04454153 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04454153 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 04454153?
The CAS number of BAS 04454153 is 488103-60-2.
What is the molecular formula of BAS 04454153?
The molecular formula of BAS 04454153 is C20H20N2OS2.
What is the molecular weight of BAS 04454153?
The molecular weight of BAS 04454153 is 368.10 g/mol.
Where can I buy BAS 04454153?
You can request a quote for BAS 04454153 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04454153?
Yes, KEHONG BIO provides custom synthesis services for BAS 04454153 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.